Home Bromides 81038-44-0
81038-44-0,MFCD00060307
Catalog No.:AA00500K

81038-44-0 | 2-(3-Bromo-4-hydroxy-5-methoxyphenyl)acetonitrile

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Purity
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Price(USD)
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250mg
95%
in stock  
$393.00   $275.00
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1g
95%
in stock  
$1,374.00   $962.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00500K
Chemical Name:
2-(3-Bromo-4-hydroxy-5-methoxyphenyl)acetonitrile
CAS Number:
81038-44-0
Molecular Formula:
C9H8BrNO2
Molecular Weight:
242.0693
MDL Number:
MFCD00060307
SMILES:
N#CCc1cc(OC)c(c(c1)Br)O
Properties
Properties
 
Form:
Solid  
MP:
145-147℃  

Computed Properties
 
Complexity:
213  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.9  

Downstream Synthesis Route

[1]Szantay;Dornyei;Blasko;etal.[ArchivderPharmazie,1981,vol.314,#12,p.983-991]

Literature
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SDS
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Tags:81038-44-0 Molecular Formula|81038-44-0 MDL|81038-44-0 SMILES|81038-44-0 2-(3-Bromo-4-hydroxy-5-methoxyphenyl)acetonitrile